Monomers
9-Vinylcarbazole
Identifiers
IUPAC name
9-ethenylcarbazole
InchI
InChI=1S/C14H11N/c1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h2-10H,1H2
InchI Key
KKFHAJHLJHVUDM-UHFFFAOYSA-N
SMILES
C=Cn1c2ccccc2c2c1cccc2
Canonical SMILES
C=CN1C2=CC=CC=C2C3=CC=CC=C31
Isomeric SMILES
C=CN1C2=CC=CC=C2C3=CC=CC=C31
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C14H11N
Heavy Atom Count
15
Molecular Weight
193.249
Exact Molecular Weight
193.0891
Valence Electrons
72
Radical Electrons
0
tPSA
4.93
MolLogP
3.895
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
3
MOL File
RDKit 3D
26 28 0 0 0 0 0 0 0 0999 V2000
0.6367 3.3528 0.4885 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1986 2.5057 -0.0201 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0694 1.1125 -0.0944 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1391 0.2593 -0.0865 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4979 0.5187 0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4175 -0.4992 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9658 -1.8091 -0.1101 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6386 -2.0708 -0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7375 -1.0257 -0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6335 -1.0017 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0142 0.3265 -0.2055 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3685 0.5973 -0.2781 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2871 -0.4196 -0.4019 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8514 -1.7232 -0.4549 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5194 -2.0592 -0.3892 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3976 4.4347 0.4734 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5735 3.1429 0.9662 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1339 2.9352 -0.4546 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8746 1.5334 0.0904 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4782 -0.2620 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6797 -2.6089 -0.1187 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2791 -3.0636 -0.2831 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7137 1.6423 -0.2512 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3525 -0.1905 -0.4575 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5702 -2.5370 -0.5525 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1916 -3.0906 -0.4325 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
13 14 1 0
14 15 2 0
11 3 1 0
9 4 1 0
15 10 1 0
1 16 1 0
1 17 1 0
2 18 1 0
5 19 1 0
6 20 1 0
7 21 1 0
8 22 1 0
12 23 1 0
13 24 1 0
14 25 1 0
15 26 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers